1-butyl-4-(4-phenylsulfanylcyclohexyl)benzene

Systemtic Name: 1-butyl-4-(4-phenylsulfanylcyclohexyl)benzene Openeye Name: 1-butyl-4-(4-phenylsulfanylcyclohexyl)benzene CAS Name: 1-butyl-4-[4-(phenylthio)cyclohexyl]benzene IUPAC Name: 1-butyl-4-(4-phenylsulfanylcyclohexyl)benzene Traditional Name: 1-butyl-4-[4-(phenylthio)cyclohexyl]benzene Formula: C22H28S MolecularWeight: 324.52272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2CCC(CC2)SC3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2CCC(CC2)SC3=CC=CC=C3

InChI

InChI=1S/C22H28S/c1-2-3-7-18-10-12-19(13-11-18)20-14-16-22(17-15-20)23-21-8-5-4-6-9-21/h4-6,8-13,20,22H,2-3,7,14-17H2,1H3